SCHEMBL11202177

SCHEMBL11202177

Cc1ccc(Cc2c(-c3ccccc3)ccc(C)c2C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
THRB P10828 2/20 0.36
TP53 P04637 2/20 0.36
ESR2 Q92731 1/20 0.36
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
LMNA P02545 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MAPK1 P28482 2/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11199823 0.82 THRB (0.36) POLBMEN1KMT2ASMN1; SMN2THRB
SCHEMBL11201347 0.81 PDCD1 (0.40) POLBMEN1KMT2ASMN1; SMN2THRB
SCHEMBL17697638 0.77 PDCD1 (0.48) POLBMEN1KMT2ASMN1; SMN2ESR2
SCHEMBL11208473 0.76 LMNA (0.38) POLBMEN1KMT2ASMN1; SMN2THRB
SCHEMBL10601329 0.75 IDH1 (0.41) MEN1KMT2ASMN1; SMN2TP53ESR2
SCHEMBL11206708 0.74 CD274 (0.44) POLBMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL9066733 0.74 IDH1 (0.49) POLBSMN1; SMN2TP53LMNAALDH1A1
SCHEMBL31345536 0.74 IDH1 (0.49) POLBSMN1; SMN2TP53LMNAALDH1A1
SCHEMBL9184965 0.73 ALDH1A1 (0.40) POLBMEN1KMT2ASMN1; SMN2TP53
SCHEMBL10759635 0.72 KDM4E (0.39) POLBMEN1KMT2ASMN1; SMN2THRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US disclosed